2-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(2-chloro-7,8-dimethyl-3-quinolinyl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(2-chloro-7,8-dimethylquinolin-3-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C20H14ClN3O4 MolecularWeight: 395.79586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C20H14ClN3O4/c1-10-3-4-12-7-13(18(21)22-17(12)11(10)2)9-23-19(25)15-6-5-14(24(27)28)8-16(15)20(23)26/h3-8H,9H2,1-2H3